- InChI
- InChI=1S/C13H19F3O4/c1-3-4-5-6-9-19-11(17)7-8-12(18)20-10(2)13(14,15)16/h3,10H,1,4-9H2,2H3
- InChI Key
- VJCBFUVHUNZZTE-UHFFFAOYSA-N
- Formula
- C13H19F3O4
- SMILES
-
C=CCCCCOC(=O)CCC(=O)OC(C)C(F)(
F)F - Molecular Weight1
- 296.28
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -905.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1278.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.04 | kJ/mol | Joback Calculated Property |
| log10WS | -3.62 | Crippen Calculated Property | |
| logPoct/wat | 3.160 | Crippen Calculated Property | |
| McVol | 209.920 | ml/mol | McGowan Calculated Property |
| Pc | 1679.66 | kPa | Joback Calculated Property |
| Inp | [1485.00; 1485.00] |
|
|
| Inp | 1485.00 | NIST | |
| Inp | 1485.00 | NIST | |
| Tboil | 640.24 | K | Joback Calculated Property |
| Tc | 810.79 | K | Joback Calculated Property |
| Tfus | 368.02 | K | Joback Calculated Property |
| Vc | 0.830 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [573.23; 645.27] | J/mol×K | [640.24; 810.79] |
|
| Cp,gas | 573.23 | J/mol×K | 640.24 | Joback Calculated Property |
| Cp,gas | 586.91 | J/mol×K | 668.67 | Joback Calculated Property |
| Cp,gas | 599.90 | J/mol×K | 697.09 | Joback Calculated Property |
| Cp,gas | 612.21 | J/mol×K | 725.52 | Joback Calculated Property |
| Cp,gas | 623.86 | J/mol×K | 753.94 | Joback Calculated Property |
| Cp,gas | 634.88 | J/mol×K | 782.37 | Joback Calculated Property |
| Cp,gas | 645.27 | J/mol×K | 810.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl hex-5-en-1-yl ester.
Sources
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